Compound Identification
SMILES
CC([O-])=O.CC[N+]1=C(SC)S\C(C1=O)=C1\SC2=CC=CC=C2N1C
InChIKey
InChIKey=XIDCQSDZQJWWNB-BNSHTTSQSA-M
Formula
C16H18N2O3S3
Mass
382.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Aryl thioethers Vinylogous thioesters Benzenoids Vinylogous amides Thiazolines Thiazoles N-acylimines Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Monocarboxylic acids and derivatives Amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Not available
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Vinylogous thioester - Benzenoid - Thiazole - Meta-thiazoline - Vinylogous amide - N-acylimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available